![4-[(2E)-2-(3-{[(4-methylphenyl)sulfonyl]oxy}benzylidene)hydrazinyl]benzoic acid structure](/static/products/845/845985-10-6.png)
4-[(2E)-2-(3-{[(4-methylphenyl)sulfonyl]oxy}benzylidene)hydrazinyl]benzoic acid
TL;DR: 4-[(2E)-2-(3-{[(4-methylphenyl)sulfonyl]oxy}benzylidene)hydrazinyl]benzoic acid (CAS 845985-10-6) is a chemical compound with molecular formula C21H18N2O5S and molecular weight 410.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2E)-2-[[3-(4-methylphenyl)sulfonyloxyphenyl]methylidene]hydrazinyl]benzoic acid
Also Known As: (E)-4-(2-(3-(tosyloxy)benzylidene)hydrazinyl)benzoic acid, 4-[(2E)-2-(3-{[(4-methylphenyl)sulfonyl]oxy}benzylidene)hydrazinyl]benzoic acid, 4-[2-[[3-(4-methylphenyl)sulfonyloxyphenyl]methylidene]hydrazinyl]benzoic Acid, 4-{N'-[1-[3-(Toluene-4-sulfonyloxy)-phenyl]-meth-(E)-ylidene]-hydrazino}-benzoic acid
| Molecular Formula | C21H18N2O5S |
|---|---|
| Molecular Weight | 410.09 g/mol |
| LogP | 3.90692 |
| Topological Polar Surface Area | 105.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 410.09363 |
| Heavy Atoms | 29 |
| Complexity | 1138.4489 |
Chemical Identifiers
| CAS Number | 845985-10-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC(=C2)/C=N/NC3=CC=C(C=C3)C(=O)O |
Product Overview
4-[(2E)-2-(3-{[(4-methylphenyl)sulfonyl]oxy}benzylidene)hydrazinyl]benzoic acid (CAS 845985-10-6), with molecular formula C21H18N2O5S and molecular weight 410.09 g/mol. IUPAC: 4-[(2E)-2-[[3-(4-methylphenyl)sulfonyloxyphenyl]methylidene]hydrazinyl]benzoic acid.
Chemical Property Profile of 4-[(2E)-2-(3-{[(4-methylphenyl)sulfonyl]oxy}benzylidene)hydrazinyl]benzoic acid
Property Insights of 4-[(2E)-2-(3-{[(4-methylphenyl)sulfonyl]oxy}benzylidene)hydrazinyl]benzoic acid
The XLogP value of 3.90692 indicates that 4-[(2E)-2-(3-{[(4-methylphenyl)sulfonyl]oxy}benzylidene)hydrazinyl]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(2E)-2-(3-{[(4-methylphenyl)sulfonyl]oxy}benzylidene)hydrazinyl]benzoic acid. Following Lipinski's Rule of Five, 4-[(2E)-2-(3-{[(4-methylphenyl)sulfonyl]oxy}benzylidene)hydrazinyl]benzoic acid has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-[(2E)-2-(3-{[(4-methylphenyl)sulfonyl]oxy}benzylidene)hydrazinyl]benzoic acid?
The CAS number of 4-[(2E)-2-(3-{[(4-methylphenyl)sulfonyl]oxy}benzylidene)hydrazinyl]benzoic acid is 845985-10-6.
What is the molecular formula of 4-[(2E)-2-(3-{[(4-methylphenyl)sulfonyl]oxy}benzylidene)hydrazinyl]benzoic acid?
The molecular formula of 4-[(2E)-2-(3-{[(4-methylphenyl)sulfonyl]oxy}benzylidene)hydrazinyl]benzoic acid is C21H18N2O5S.
What is the molecular weight of 4-[(2E)-2-(3-{[(4-methylphenyl)sulfonyl]oxy}benzylidene)hydrazinyl]benzoic acid?
The molecular weight of 4-[(2E)-2-(3-{[(4-methylphenyl)sulfonyl]oxy}benzylidene)hydrazinyl]benzoic acid is 410.09 g/mol.
Where can I buy 4-[(2E)-2-(3-{[(4-methylphenyl)sulfonyl]oxy}benzylidene)hydrazinyl]benzoic acid?
You can request a quote for 4-[(2E)-2-(3-{[(4-methylphenyl)sulfonyl]oxy}benzylidene)hydrazinyl]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(2E)-2-(3-{[(4-methylphenyl)sulfonyl]oxy}benzylidene)hydrazinyl]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[(2E)-2-(3-{[(4-methylphenyl)sulfonyl]oxy}benzylidene)hydrazinyl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.